forked from BalunasLab/mpact
-
Notifications
You must be signed in to change notification settings - Fork 0
Expand file tree
/
Copy path.gitignore
More file actions
472 lines (471 loc) · 18.9 KB
/
.gitignore
File metadata and controls
472 lines (471 loc) · 18.9 KB
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
code/__pycache__/
code/__pycache__/stats.cpython-39.pyc
code/__pycache__/plotting.cpython-39.pyc
code/__pycache__/MSFaST.cpython-39.pyc
code/__pycache__/main.cpython-39.pyc
code/averagepca.csv
code/msdata_teststats_test.csv
code/qdata.csv
*.pyc
rawdata/*
processeddata/*
!rawdata/200826_PTY087I2codingdataset
!processeddata/PTY087I2
code/__pycache__/files.cpython-38.pyc
code/__pycache__/files.cpython-39.pyc
code/__pycache__/files_rc.cpython-38.pyc
code/__pycache__/files_rc.cpython-39.pyc
code/__pycache__/main.cpython-38.pyc
code/__pycache__/main.cpython-39.pyc
code/__pycache__/plotting.cpython-38.pyc
code/__pycache__/plotting.cpython-39.pyc
code/__pycache__/stats.cpython-39.pyc
code/__pycache__/ui_featureinfo.cpython-38.pyc
code/__pycache__/ui_featureinfo.cpython-39.pyc
code/__pycache__/ui_functions.cpython-38.pyc
code/__pycache__/ui_main.cpython-38.pyc
code/__pycache__/ui_main.cpython-39.pyc
code/__pycache__/ui_plotparam.cpython-39.pyc
code/compoundimages/(+)-5(6),13-halimadiene-15-ol.png
code/compoundimages/(+)-caryolan-1-ol.png
code/compoundimages/(+)-discoipyrrole A.png
code/compoundimages/(-)-7-Geranylindolactam V.png
code/compoundimages/(-)-Neoverrucosan-5beta-ol.png
code/compoundimages/(-)-Verrucosan-2beta-ol.png
code/compoundimages/(1S,3aR)-jadomycin V.png
code/compoundimages/(2E,4E)-7-methylocta-2,4-dienoic acid amide.png
code/compoundimages/(2S,3S)-3-Hydroxy-1,4-diphenylbutan-2-yl-acetate.png
code/compoundimages/(5R) 5-hydroxy-3-\[\[2-(4-hydroxyphenyl)ethyl\]amino\]-5-vinyl-2-cyclopenten-1-one.png
code/compoundimages/(5S,S)-5-methyl-3-(2-methylbutyl)furan-2(5H)-one.png
code/compoundimages/(5S,S)-5-methyl-3-(3-methylpentyl)furan-2(5H)-one.png
code/compoundimages/(E)-12-methyltridec-3-enenitrile.png
code/compoundimages/(E)-ethyl 8-oxooctadec-9-enoate.png
code/compoundimages/(E)-tetradec-3-enenitrile.png
code/compoundimages/(S)-N-tetradecanoyl-HSL.png
code/compoundimages/(Z)-12-methyltridec-3-enenitrile.png
code/compoundimages/(Z)-15-Methylhexadec-10-en-2-one.png
code/compoundimages/(Z)-octadec-11-enenitrile.png
code/compoundimages/(Z)-tetradec-3-enenitrile.png
code/compoundimages/(Z)-tetradec-7-enenitrile.png
code/compoundimages/-L-glutamyl-L-leucine.png
code/compoundimages/1 '- (beta- Glucopyranosyloxy) di- O-demethylspirilloxan thin.png
code/compoundimages/1'-beta-glucopyranosyl-3,4,3',4'-tetradehydro-1', 2'-dihydro-beta,psi-caroten-2-one.png
code/compoundimages/1,4-dihydroxy-2,5-dimethoxy-9,10-anthraquinone.png
code/compoundimages/1-hydroxymethylindole-3-carboxylic acid.png
code/compoundimages/1-methyl-pseudouridine.png
code/compoundimages/1-methylthio-2,3-di-O-(3',7',11',15'-tetramethylhexadecyl)glycerol (diphytanylglyceryl methylthioether).png
code/compoundimages/10,15-dihydroxyamorph-4-en-3-one.png
code/compoundimages/12-Deoxy-deoxysaxitoxin.png
code/compoundimages/12-hydroxy-13-butoxyethoxyfumitremorgin B.png
code/compoundimages/16-methyloxazolomycin.png
code/compoundimages/17-Methylenespiramycin.png
code/compoundimages/17-O-ethylnotoamide M.png
code/compoundimages/18-methyltacrolimus.png
code/compoundimages/2-(2-carboxyethyl)-8-hydroxyquinazolin-4(3H)-one.png
code/compoundimages/2-(furan-2-yl)-6-(2S,3S,4-trihydroxybutyl)pyrazine.png
code/compoundimages/2-(Heptadecyl)-3,6-dihydroxy-1,4-benzoquinone.png
code/compoundimages/2-amino-4-methoxy-5-cyanopyrrolo\[2,3-d\]pyrimidine.png
code/compoundimages/2-amino-6-hydroxyphenoxazin-3-one.png
code/compoundimages/2-Demethylmonensin B.png
code/compoundimages/2-ethyl-7-hydroxy-6,7-dihydro-5H-indolizin-3-one.png
code/compoundimages/23-(6-methyl)heptanoic acid demalonylazalomycin F3a ester.png
code/compoundimages/3-hydroxydehydrodaidzein.png
code/compoundimages/3-Isobutylpropanamide-2-cyclopenten-1-one.png
code/compoundimages/3-N-formyl- holyrine A.png
code/compoundimages/4,5-dihydroxy-7-methylphthalide.png
code/compoundimages/4-\[2-O-9Z-hexadecenoyl--glucopyranosyl\]-4,4-diapolycopene-4,4-dioic acid.png
code/compoundimages/4-desmethylepothilone D.png
code/compoundimages/4-methoxy-3H-isobenzofuran-1-one.png
code/compoundimages/4-quinolinecarboxylic acid.png
code/compoundimages/41-Demethylhomooligomycin B.png
code/compoundimages/5'-deoxyguanosine.png
code/compoundimages/5,18-dedihydroxycyclooctatin.png
code/compoundimages/5,7,3',4'-Tetrahydroxy-8-methylisoflavon.png
code/compoundimages/5-Hydroxy-3-(1-hydroxy-2-methylbutyl)-4-methyl-2(5H)-furanone.png
code/compoundimages/5-hydroxydeoxyvasicinone.png
code/compoundimages/6-acetylphenazine-1-carboxylic acid.png
code/compoundimages/6-deoxyerythronolide B.png
code/compoundimages/6-Hydroxysordarin.png
code/compoundimages/7-Hydroxy-8,16-dimethyl-9-octadecenoic acid.png
code/compoundimages/7-Tetradecenoic acid.png
code/compoundimages/8,9-dihydrolactimidomycin.png
code/compoundimages/8-desmethoxy-isomigrastatin.png
code/compoundimages/8-hydroxy-8,9-dihydrolactidomycin.png
code/compoundimages/\[D-Asp, Dhb^7\]microcystin-LR.png
code/compoundimages/\[D-Asp3,Ser7\]MC-LR.png
code/compoundimages/Abenquine B2.png
code/compoundimages/Abenquine C.png
code/compoundimages/Abyssomicin C.png
code/compoundimages/Abyssomicin P.png
code/compoundimages/Acidiphilamide C.png
code/compoundimages/Actiketal.png
code/compoundimages/Actinoallolide D.png
code/compoundimages/Actinoramide E.png
code/compoundimages/AHB-6-Methylneamine.png
code/compoundimages/AI-77-F.png
code/compoundimages/Albatrelin F.png
code/compoundimages/Albogrisin B.png
code/compoundimages/Albucyclone A.png
code/compoundimages/Albumycin.png
code/compoundimages/Aldgamycin E.png
code/compoundimages/Aldgamycin I.png
code/compoundimages/Aldgamycin K.png
code/compoundimages/Alokicenone C.png
code/compoundimages/AM-2604 A.png
code/compoundimages/Amphibactin T.png
code/compoundimages/Amycolatopsin C.png
code/compoundimages/Ananstrep C.png
code/compoundimages/AnhydroSEK4b.png
code/compoundimages/Antarlide F.png
code/compoundimages/Antascomicin B.png
code/compoundimages/Antascomicin E.png
code/compoundimages/Antillatoxin.png
code/compoundimages/Aquayamycin.png
code/compoundimages/Argimicin B.png
code/compoundimages/Arthripenoid B.png
code/compoundimages/Ashimide B.png
code/compoundimages/Aspergilone A.png
code/compoundimages/Asterobactin B.png
code/compoundimages/Azicemicin A.png
code/compoundimages/Bacillamidin G.png
code/compoundimages/Bacilysocin.png
code/compoundimages/Bafilomycin C2.png
code/compoundimages/Bafilomycin G.png
code/compoundimages/Balgacyclamide C.png
code/compoundimages/Bananamide 2.png
code/compoundimages/Banegasine.png
code/compoundimages/Bartoloside H.png
code/compoundimages/Bartoloside I.png
code/compoundimages/BE-10988.png
code/compoundimages/BE-14106.png
code/compoundimages/BE-32030A.png
code/compoundimages/Benzastatin A.png
code/compoundimages/Biphenomycin C.png
code/compoundimages/Biseokeaniamide A.png
code/compoundimages/Blastmycetin C.png
code/compoundimages/Brasilibactin A.png
code/compoundimages/Brasiliquinone C.png
code/compoundimages/Brintonamide A.png
code/compoundimages/Brintonamide B.png
code/compoundimages/Caerulomycin G.png
code/compoundimages/Caldorin.png
code/compoundimages/Carboxymycobactin-7.png
code/compoundimages/Cepafungin I.png
code/compoundimages/Cephamycin C.png
code/compoundimages/Chaiyaphumine D.png
code/compoundimages/Chejuenolide A.png
code/compoundimages/Chlorotonil B.png
code/compoundimages/Chrondamide 12D.png
code/compoundimages/Circumdatin D.png
code/compoundimages/Cis-7-tetradecenoyl-D-asparagine.png
code/compoundimages/Citreamicin alpha.png
code/compoundimages/Citreo-g-pyrone.png
code/compoundimages/Clavirolide A.png
code/compoundimages/Coibacin C.png
code/compoundimages/Columbamide B.png
code/compoundimages/Concanamycin B.png
code/compoundimages/Conglobatin.png
code/compoundimages/Coronafacoyl-L-isoleucine.png
code/compoundimages/Coronatine.png
code/compoundimages/Cosmomycin A.png
code/compoundimages/Crocagin A.png
code/compoundimages/Cryptophycin-16.png
code/compoundimages/Cryptophycin-38.png
code/compoundimages/Cyanopeptolin 920.png
code/compoundimages/Cyclo(D)-Pro-(D)-Leu.png
code/compoundimages/Cyclo-(L-Ala-L-Tyr).png
code/compoundimages/Cyclodysidin D.png
code/compoundimages/Cylindrocyclophane C2.png
code/compoundimages/Daryamide E.png
code/compoundimages/Defumarylhygrolidin.png
code/compoundimages/Dehydro tilivalline.png
code/compoundimages/Dehydroxynocardamine.png
code/compoundimages/Demethylblasticidin S.png
code/compoundimages/Deoxynybomycin.png
code/compoundimages/Desferrioxamine X4.png
code/compoundimages/Desotamide A.png
code/compoundimages/Desotamide C.png
code/compoundimages/Desotamide G.png
code/compoundimages/Diaphorin.png
code/compoundimages/Dietziamide A.png
code/compoundimages/Dihydromaltophilin.png
code/compoundimages/Dioxolide A.png
code/compoundimages/Diploptene.png
code/compoundimages/DKxanthene 574.png
code/compoundimages/Dokdolipid B.png
code/compoundimages/Dolastatin 10.png
code/compoundimages/Dragonamide D.png
code/compoundimages/Eicosanedioic acid.png
code/compoundimages/Emericellamide A.png
code/compoundimages/Enniatin L.png
code/compoundimages/Enniatin M1.png
code/compoundimages/Epohelmin B.png
code/compoundimages/Eponemycin.png
code/compoundimages/Epothilone D.png
code/compoundimages/Epothilone D1.png
code/compoundimages/Epothilone I1.png
code/compoundimages/Erythromycin G.png
code/compoundimages/ethyl homononactyl homononactate.png
code/compoundimages/Etrogol.png
code/compoundimages/Eurystatin C.png
code/compoundimages/F-Met I.png
code/compoundimages/Flexirubin.png
code/compoundimages/Fluvirucin B2.png
code/compoundimages/Fluvirucin B6.png
code/compoundimages/Fontonamide.png
code/compoundimages/Formicamycin D.png
code/compoundimages/FR-66979.png
code/compoundimages/FR-900848.png
code/compoundimages/Frenolicin G.png
code/compoundimages/Fumaquinone.png
code/compoundimages/Furaquinocin B.png
code/compoundimages/Furaquinocin D.png
code/compoundimages/Fusaricidin D.png
code/compoundimages/Geralcin E.png
code/compoundimages/GGL.3.png
code/compoundimages/Glidobactin C.png
code/compoundimages/Gln-Asp-Val-Leu.png
code/compoundimages/Glomecidin.png
code/compoundimages/Glycocinnasperimicin D.png
code/compoundimages/Gobichelin B.png
code/compoundimages/Griselimycin.png
code/compoundimages/Guineamide C.png
code/compoundimages/H2-6-Hydroxymethylpterin.png
code/compoundimages/Halstoctacosanolide B.png
code/compoundimages/Hapalindole D.png
code/compoundimages/Heliomycin.png
code/compoundimages/Hexadecanenitrile.png
code/compoundimages/Hexose-palythine-serine.png
code/compoundimages/Homorapamycin A.png
code/compoundimages/Hoshinolactam.png
code/compoundimages/IC-202-A.png
code/compoundimages/Ilanefuranone.png
code/compoundimages/Indigoidine.png
code/compoundimages/Indisocin.png
code/compoundimages/Indole-3-acetic acid methyl ester.png
code/compoundimages/Inonotusic acid.png
code/compoundimages/Iromycin C.png
code/compoundimages/Isobongkrekic acid,.png
code/compoundimages/Isobutyrylvalindomycin.png
code/compoundimages/Isomalyngamide A.png
code/compoundimages/Isorhizopodin.png
code/compoundimages/Isotuberculosino.png
code/compoundimages/Izenamide B.png
code/compoundimages/JBIR-05.png
code/compoundimages/JBIR-80.png
code/compoundimages/Jomthonic acid E.png
code/compoundimages/Juglomycin I.png
code/compoundimages/Kalafungin.png
code/compoundimages/Kalimantacin B.png
code/compoundimages/Kandenol A.png
code/compoundimages/Kijimicin.png
code/compoundimages/Koreenceine A.png
code/compoundimages/Koreenceine B.png
code/compoundimages/Koreenceine C.png
code/compoundimages/Korormicin K.png
code/compoundimages/Kribelloside A.png
code/compoundimages/Kribelloside B.png
code/compoundimages/L--(3-hydroxyureido)-alanine.png
code/compoundimages/Lactoquinomycin.png
code/compoundimages/Lagunamide B.png
code/compoundimages/Landomycin A.png
code/compoundimages/Landomycin S.png
code/compoundimages/Lentzeoside E.png
code/compoundimages/Leptofuranin D.png
code/compoundimages/Leualacin G.png
code/compoundimages/Leupyrrin B2.png
code/compoundimages/Leuseramycin.png
code/compoundimages/Lipoamide C.png
code/compoundimages/Lipstatin.png
code/compoundimages/Lobarialide C.png
code/compoundimages/Lobosamide C.png
code/compoundimages/Lodopyridone.png
code/compoundimages/Luminmide B.png
code/compoundimages/Lutoside.png
code/compoundimages/Lyngbyatoxin A.png
code/compoundimages/Maculalactone K.png
code/compoundimages/Maculalactone M.png
code/compoundimages/Mandelalide A.png
code/compoundimages/Mansouramycin D.png
code/compoundimages/Maremycin D2.png
code/compoundimages/Marformycin D.png
code/compoundimages/Maridomycin III.png
code/compoundimages/Marinactinone A.png
code/compoundimages/Marinobactin-D1.png
code/compoundimages/Martinomycin.png
code/compoundimages/Matlystatin A.png
code/compoundimages/Mer-WF3010.png
code/compoundimages/Metacridamide A.png
code/compoundimages/methyl 1-(methyl propionate)--carboline-3-carboxylate.png
code/compoundimages/Microginin 576.png
code/compoundimages/Microginin 91-A.png
code/compoundimages/Microginin FR9.png
code/compoundimages/Microtermolide A.png
code/compoundimages/Milbemycin 10.png
code/compoundimages/Milbemycin 26.png
code/compoundimages/Minutissamide J.png
code/compoundimages/MKN-004C.png
code/compoundimages/Mohangic acid A.png
code/compoundimages/Mohangic acid E.png
code/compoundimages/Monactin.png
code/compoundimages/Mupirocin F.png
code/compoundimages/Mutaxanthene B.png
code/compoundimages/Mycemycin A.png
code/compoundimages/Mycemycin E.png
code/compoundimages/Myxochromide S3.png
code/compoundimages/Myxopyronin B.png
code/compoundimages/Myxotyroside B.png
code/compoundimages/N,N'-diisobutylurea.png
code/compoundimages/N-Acetyl-tyramine.png
code/compoundimages/N-carboxamido-staurosporine.png
code/compoundimages/N-methylphloretamide.png
code/compoundimages/N-Tetradecadienoyl-L-homoserine lactone.png
code/compoundimages/Nai414-B.png
code/compoundimages/Namalide C.png
code/compoundimages/Namalide E.png
code/compoundimages/Naphthacemycin B3.png
code/compoundimages/Naphthgeranine A.png
code/compoundimages/Neomacrophorin III.png
code/compoundimages/Nevaltophin A.png
code/compoundimages/Nigerapyrone H.png
code/compoundimages/Nitrosoxacin C.png
code/compoundimages/Nocapyrone R.png
code/compoundimages/Nocardichelin B.png
code/compoundimages/Nocardiopyrone A.png
code/compoundimages/Nostopeptolide A3.png
code/compoundimages/Nostopeptolide L3.png
code/compoundimages/Nostophycin.png
code/compoundimages/Not named.png
code/compoundimages/NP-101A.png
code/compoundimages/NW-G03.png
code/compoundimages/Obscurolide-C2 methyl ester.png
code/compoundimages/Octacyclomycin.png
code/compoundimages/Odyverdiene B.png
code/compoundimages/Okaramine H.png
code/compoundimages/Oryzamide B.png
code/compoundimages/Oscillamide B.png
code/compoundimages/Oscillatoxin E.png
code/compoundimages/Oxepinamide C.png
code/compoundimages/Palmyrrolinone.png
code/compoundimages/Panclicin E.png
code/compoundimages/Panosialin C.png
code/compoundimages/Paulomycin E.png
code/compoundimages/PD-118576-A3.png
code/compoundimages/Pepsatin Pr.png
code/compoundimages/Pestabacillin B.png
code/compoundimages/Phe+CO\[Lys+Val+Leu+MeHty+MetO\].png
code/compoundimages/Phenalinolactone A.png
code/compoundimages/Phenoxan.png
code/compoundimages/Phenylbutenote.png
code/compoundimages/Phenylnannolone A.png
code/compoundimages/Phenylnannolone C.png
code/compoundimages/Photopyrone A.png
code/compoundimages/Phototemtide A.png
code/compoundimages/Piericidin B5.png
code/compoundimages/Pimprinol A.png
code/compoundimages/Planktocyclin.png
code/compoundimages/Planktopeptin BL843.png
code/compoundimages/PM-toxin B.png
code/compoundimages/Porpoisamide B.png
code/compoundimages/Poststatin.png
code/compoundimages/Pseudoaeruginosin NS1.png
code/compoundimages/Pseudodestruxin A.png
code/compoundimages/Psi-tectorigenin.png
code/compoundimages/Psuedodestruxin C.png
code/compoundimages/Pukeleimide E.png
code/compoundimages/Pulicatin A.png
code/compoundimages/Pyonitrin A.png
code/compoundimages/Pyridindolol K2.png
code/compoundimages/Pyridinopyrone C.png
code/compoundimages/Pyrroindomycin B.png
code/compoundimages/Qinimycin C.png
code/compoundimages/Quinolobactin.png
code/compoundimages/Rakicidin B.png
code/compoundimages/Ralfuranone B.png
code/compoundimages/Ralfuranone I.png
code/compoundimages/Ralstonin B.png
code/compoundimages/Rhabdopeptide 8.png
code/compoundimages/Rhizomide B.png
code/compoundimages/RHM2.png
code/compoundimages/Rhodopeptin C1.png
code/compoundimages/Rhodopeptin C4.png
code/compoundimages/Ribocyclophane C.png
code/compoundimages/Rifamycin Z.png
code/compoundimages/RK-144171.png
code/compoundimages/Roquefortine A.png
code/compoundimages/Roseobacticide H.png
code/compoundimages/Salinipostin D.png
code/compoundimages/Salinosporamide I.png
code/compoundimages/Sanglifehrin C.png
code/compoundimages/Sarpeptin B.png
code/compoundimages/SCH 38518.png
code/compoundimages/Sch 39185.png
code/compoundimages/Sclerolizine.png
code/compoundimages/Semiplenamide F.png
code/compoundimages/Serinolamides D.png
code/compoundimages/Serratamolide C.png
code/compoundimages/Serratamolide D.png
code/compoundimages/Serratamolide E.png
code/compoundimages/SF-1902-A3.png
code/compoundimages/SF-1902-A4b.png
code/compoundimages/SF-2140.png
code/compoundimages/SF2738C.png
code/compoundimages/Shikometabolin A.png
code/compoundimages/Siastatin B.png
code/compoundimages/Silalthride.png
code/compoundimages/Sordarin-1-glucose ester.png
code/compoundimages/Spliceostatin E.png
code/compoundimages/Spongiporic acid A.png
code/compoundimages/Sporminarin B.png
code/compoundimages/Stoloniferone L.png
code/compoundimages/Strepantibin C.png
code/compoundimages/Streptoaminal-8n.png
code/compoundimages/Streptoaminal9n.png
code/compoundimages/Streptofactin.png
code/compoundimages/Streptoone C.png
code/compoundimages/Streptovirudin D1.png
code/compoundimages/Strevertene B.png
code/compoundimages/Syringolin G.png
code/compoundimages/T1801 A.png
code/compoundimages/Tasipeptin A.png
code/compoundimages/Tasipeptin B.png
code/compoundimages/Tautomycin.png
code/compoundimages/Teixobactin.png
code/compoundimages/Tenacibactin A.png
code/compoundimages/Tenacibactin B.png
code/compoundimages/Terresterol.png
code/compoundimages/Tetradecanenitrile.png
code/compoundimages/Tetronomycin.png
code/compoundimages/Thailandamide lactone.png
code/compoundimages/Thaxteramide A2.png
code/compoundimages/Thaxtomin B.png
code/compoundimages/Tjipanazole C1.png
code/compoundimages/Trichophycin C.png
code/compoundimages/Triedimycin A.png
code/compoundimages/Trierixin.png
code/compoundimages/Tyromycic acid G.png
code/compoundimages/U-77864.png
code/compoundimages/UK-78629.png
code/compoundimages/Unguisin E.png
code/compoundimages/USF-142A.png
code/compoundimages/Uvidin-A ester 2a.png
code/compoundimages/Violapyrone B.png
code/compoundimages/Violapyrone E.png
code/compoundimages/VLP T.png
code/compoundimages/Wortmanamide B.png
code/compoundimages/Xanthocillin-X dimethylether.png
code/compoundimages/Xefoampeptide C.png
code/compoundimages/Xentrivalpeptide O.png
code/compoundimages/Yanucamide A.png
code/compoundimages/Yatakemycin.png
code/compoundimages/Yicathin C.png
code/compoundimages/YM-47515 degradation product.png
code/compoundimages/Ypaoamide C.png
code/compoundimages/Z-4-2.png
code/test_upsetplt.png
code/test_upsetplt.png
code/treemap.png
code/untitled0.py
code/test_upsetplt.png
code/test_upsetplt.png
code/treemap.png